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2-(2'-Methoxy-6'-methylbenzoyl)-5-methyl-1,3-cyclohexanedione
SpectraBase Compound ID 3PMb1PU0JMj
InChI InChI=1S/C16H18O4/c1-9-7-11(17)15(12(18)8-9)16(19)14-10(2)5-4-6-13(14)20-3/h4-6,9,15H,7-8H2,1-3H3
InChIKey ITCGODVZKREEST-UHFFFAOYSA-N
Mol Weight 274.32 g/mol
Molecular Formula C16H18O4
Exact Mass 274.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1MYUHIBxBSH
Name 2-(2'-Methoxy-6'-methylbenzoyl)-5-methyl-1,3-cyclohexanedione
Alternate Name(s) 2-(2-Methoxy-6-methylbenzoyl)-5-methyl-1,3-cyclohexanedione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O4
InChI InChI=1S/C16H18O4/c1-9-7-11(17)15(12(18)8-9)16(19)14-10(2)5-4-6-13(14)20-3/h4-6,9,15H,7-8H2,1-3H3
InChIKey ITCGODVZKREEST-UHFFFAOYSA-N
Molecular Weight 274.316 g/mol
SMILES C1(C(c2c(OC)cccc2C)=O)C(CC(CC1=O)C)=O
SPLASH splash10-0007-0970000000-5935ab9d73fa20683015
Source of Spectrum KC-60-1872-4
Wiley ID 1583467